propan-2-yl (6R)-6-[4-(3,3-dimethylbutanoylamino)phenyl]-3,4-dimethyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: propan-2-yl (6R)-6-[4-(3,3-dimethylbutanoylamino)phenyl]-3,4-dimethyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: isopropyl (6R)-6-[4-(3,3-dimethylbutanoylamino)phenyl]-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6R)-6-[4-[(3,3-dimethyl-1-oxobutyl)amino]phenyl]-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl (6R)-6-[4-(3,3-dimethylbutanoylamino)phenyl]-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6R)-6-[4-(3,3-dimethylbutanoylamino)phenyl]-2-keto-3,4-dimethyl-1,6-dihydropyrimidine-5-carboxylic acid isopropyl ester Formula: C22H31N3O4 MolecularWeight: 401.49924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1C)C2=CC=C(C=C2)NC(=O)CC(C)(C)C)C(=O)OC(C)C

Isomeric SMILES

CC1=C([C@H](NC(=O)N1C)C2=CC=C(C=C2)NC(=O)CC(C)(C)C)C(=O)OC(C)C

InChI

InChI=1S/C22H31N3O4/c1-13(2)29-20(27)18-14(3)25(7)21(28)24-19(18)15-8-10-16(11-9-15)23-17(26)12-22(4,5)6/h8-11,13,19H,12H2,1-7H3,(H,23,26)(H,24,28)/t19-/m1/s1